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36848-69-8,MFCD03412574
Catalog No.:AA0077OD

36848-69-8 | Ethyl 2-cyano-2-(3,4-dimethoxyphenyl)acetate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
95%
2 weeks  
$162.00   $114.00
- +
250mg
95%
2 weeks  
$258.00   $180.00
- +
500mg
95%
2 weeks  
$343.00   $240.00
- +
1g
95%
2 weeks  
$472.00   $330.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA0077OD
Chemical Name:
Ethyl 2-cyano-2-(3,4-dimethoxyphenyl)acetate
CAS Number:
36848-69-8
Molecular Formula:
C13H15NO4
Molecular Weight:
249.2625
MDL Number:
MFCD03412574
SMILES:
CCOC(=O)C(c1ccc(c(c1)OC)OC)C#N
Properties
Computed Properties
 
Complexity:
322  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
6  
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0  
XLogP3:
2  

Downstream Synthesis Route

[1]Osuka,Atsuhiro;Kobayashi,Tsutomu;Suzuki,Hitomi[Synthesis,1983,#1,p.67-68]

[2]Suzuki,Hitomi;Kobayashi,Tsutomu;Yoshida,Yoshiki;Osuka,Atsuhiro[ChemistryLetters,1983,p.193-194]

[1]El-Hawash;El-Mallah[Pharmazie,1998,vol.53,#6,p.368-373]

[2]El-Hawash;El-Mallah[Pharmazie,1998,vol.53,#6,p.368-373]

[1]El-Hawash;El-Mallah[Pharmazie,1998,vol.53,#6,p.368-373]

36848-69-8    78-94-4   
(S)-ethyl2-cyano-2-(3',4'-dimethoxyphenyl)-5-oxohexanoate 
 
2-cyano-2-(3,4-dimethoxy-phenyl)-5-oxo-hexanoicacidethylester 

[1]Liu,Tian-Yu;Li,Rui;Chai,Qian;Long,Jun;Li,Bang-Jing;Wu,Yong;Ding,Li-Sheng;Chen,Ying-Chun[Chemistry-AEuropeanJournal,2007,vol.13,#1,p.319-327]

36848-69-8   
α-aminomethyl-(3,4-dimethoxy)benzeneaceticacidethylesterhydrochloride 

[1]CurrentPatentAssignee:CHENSHOQING;ROCHEHOLDINGAG-WO2004/101528,2004,A2Locationinpatent:Page84

Literature
Quotation Request
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SDS
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Tags:36848-69-8 Molecular Formula|36848-69-8 MDL|36848-69-8 SMILES|36848-69-8 Ethyl 2-cyano-2-(3,4-dimethoxyphenyl)acetate
Catalog No.: AA0077OD
36848-69-8,MFCD03412574
36848-69-8 | Ethyl 2-cyano-2-(3,4-dimethoxyphenyl)acetate
Pack Size： 100mg
Purity： 95%
2 weeks
$162.00 $114.00
Pack Size： 250mg
Purity： 95%
2 weeks
$258.00 $180.00
Pack Size： 500mg
Purity： 95%
2 weeks
$343.00 $240.00
Pack Size： 1g
Purity： 95%
2 weeks
$472.00 $330.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA0077OD
Chemical Name: Ethyl 2-cyano-2-(3,4-dimethoxyphenyl)acetate
CAS Number: 36848-69-8
Molecular Formula: C13H15NO4
Molecular Weight: 249.2625
MDL Number: MFCD03412574
SMILES: CCOC(=O)C(c1ccc(c(c1)OC)OC)C#N
Properties
Complexity: 322  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 18  
Hydrogen Bond Acceptor Count: 5  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 6  
Undefined Atom Stereocenter Count: 1  
Undefined Bond Stereocenter Count: 0  
XLogP3: 2  
Downstream Synthesis Route
5460-32-2    105-56-6    36848-69-8 

[1]Osuka,Atsuhiro;Kobayashi,Tsutomu;Suzuki,Hitomi[Synthesis,1983,#1,p.67-68]

[2]Suzuki,Hitomi;Kobayashi,Tsutomu;Yoshida,Yoshiki;Osuka,Atsuhiro[ChemistryLetters,1983,p.193-194]

36848-69-8    209003-26-9 

[1]El-Hawash;El-Mallah[Pharmazie,1998,vol.53,#6,p.368-373]

[2]El-Hawash;El-Mallah[Pharmazie,1998,vol.53,#6,p.368-373]

36848-69-8    209003-25-8 

[1]El-Hawash;El-Mallah[Pharmazie,1998,vol.53,#6,p.368-373]

36848-69-8    78-94-4   
(S)-ethyl2-cyano-2-(3',4'-dimethoxyphenyl)-5-oxohexanoate 
 
2-cyano-2-(3,4-dimethoxy-phenyl)-5-oxo-hexanoicacidethylester 

[1]Liu,Tian-Yu;Li,Rui;Chai,Qian;Long,Jun;Li,Bang-Jing;Wu,Yong;Ding,Li-Sheng;Chen,Ying-Chun[Chemistry-AEuropeanJournal,2007,vol.13,#1,p.319-327]

36848-69-8   
α-aminomethyl-(3,4-dimethoxy)benzeneaceticacidethylesterhydrochloride 

[1]CurrentPatentAssignee:CHENSHOQING;ROCHEHOLDINGAG-WO2004/101528,2004,A2Locationinpatent:Page84

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